N3-[bis(azanyl)methylidene]-N1-(2-dimethylaminoethyl)-5-pyrrol-1-yl-benzene-1,3-dicarboxamide

Systemtic Name: N3-[bis(azanyl)methylidene]-N1-(2-dimethylaminoethyl)-5-pyrrol-1-yl-benzene-1,3-dicarboxamide Openeye Name: N3-(diaminomethylene)-N1-(2-dimethylaminoethyl)-5-pyrrol-1-yl-benzene-1,3-dicarboxamide CAS Name: N3-(diaminomethylidene)-N1-(2-dimethylaminoethyl)-5-(1-pyrrolyl)benzene-1,3-dicarboxamide IUPAC Name: 3-N-(diaminomethylidene)-1-N-(2-dimethylaminoethyl)-5-pyrrol-1-ylbenzene-1,3-dicarboxamide Traditional Name: N'-(diaminomethylene)-N-(2-dimethylaminoethyl)-5-pyrrol-1-yl-isophthalamide Formula: C17H22N6O2 MolecularWeight: 342.39558

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCNC(=O)C1=CC(=CC(=C1)C(=O)N=C(N)N)N2C=CC=C2

Isomeric SMILES

CN(C)CCNC(=O)C1=CC(=CC(=C1)C(=O)N=C(N)N)N2C=CC=C2

InChI

InChI=1S/C17H22N6O2/c1-22(2)8-5-20-15(24)12-9-13(16(25)21-17(18)19)11-14(10-12)23-6-3-4-7-23/h3-4,6-7,9-11H,5,8H2,1-2H3,(H,20,24)(H4,18,19,21,25)